! Pwscf input file created with ciftopw.py 
! Compound: Na2SeO4
&control
         calculation     = 'bands'
         prefix          = 'Na2SeO4'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           15.2879495022303065
         celldm(2)       =            0.8646126017857420
         celldm(3)       =            0.7325438131679773
         celldm(4)       =            0.2243372036765514
         celldm(5)       =            0.5385790398198562
         celldm(6)       =            0.7002757711690797
         nat             =       14
         ntyp            =        3
         ecutwfc         =       67.00000000
         ecutrho         =      324.00000000
         occupations     =  'smearing'  
         smearing        =  'f-d' 
         degauss         =        1.00000000e-03  
         noncolin        =  .true. 
         lspinorb        =  .true. 
/
&electrons
         conv_thr        =        1.00000000e-05 
         mixing_beta     =        3.00000000e-01    
   /
ATOMIC_SPECIES
 O  15.9994 O.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Se  78.9600 Se.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Na  22.9898 Na.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
326
      0.00000000       0.00000000       0.00000000 1.0 
      0.01612903       0.00000000       0.01612903 1.0 
      0.03225806       0.00000000       0.03225806 1.0 
      0.04838710      -0.00000000       0.04838710 1.0 
      0.06451613       0.00000000       0.06451613 1.0 
      0.08064516       0.00000000       0.08064516 1.0 
      0.09677419      -0.00000000       0.09677419 1.0 
      0.11290323      -0.00000000       0.11290323 1.0 
      0.12903226       0.00000000       0.12903226 1.0 
      0.14516129       0.00000000       0.14516129 1.0 
      0.16129032       0.00000000       0.16129032 1.0 
      0.17741935      -0.00000000       0.17741935 1.0 
      0.19354839      -0.00000000       0.19354839 1.0 
      0.20967742      -0.00000000       0.20967742 1.0 
      0.22580645      -0.00000000       0.22580645 1.0 
      0.24193548       0.00000000       0.24193548 1.0 
      0.25806452       0.00000000       0.25806452 1.0 
      0.27419355       0.00000000       0.27419355 1.0 
      0.29032258       0.00000000       0.29032258 1.0 
      0.30645161       0.00000000       0.30645161 1.0 
      0.32258065       0.00000000       0.32258065 1.0 
      0.33870968       0.00000000       0.33870968 1.0 
      0.35483871      -0.00000000       0.35483871 1.0 
      0.37096774      -0.00000000       0.37096774 1.0 
      0.38709677      -0.00000000       0.38709677 1.0 
      0.40322581      -0.00000000       0.40322581 1.0 
      0.41935484      -0.00000000       0.41935484 1.0 
      0.43548387       0.00000000       0.43548387 1.0 
      0.45161290      -0.00000000       0.45161290 1.0 
      0.46774194       0.00000000       0.46774194 1.0 
      0.48387097       0.00000000       0.48387097 1.0 
      0.50000000       0.00000000       0.50000000 1.0 
      0.50000000       0.00000000       0.50000000 1.0 
      0.52000000       0.02000000       0.50000000 1.0 
      0.54000000       0.04000000       0.50000000 1.0 
      0.56000000       0.06000000       0.50000000 1.0 
      0.58000000       0.08000000       0.50000000 1.0 
      0.60000000       0.10000000       0.50000000 1.0 
      0.62000000       0.12000000       0.50000000 1.0 
      0.64000000       0.14000000       0.50000000 1.0 
      0.66000000       0.16000000       0.50000000 1.0 
      0.68000000       0.18000000       0.50000000 1.0 
      0.70000000       0.20000000       0.50000000 1.0 
      0.72000000       0.22000000       0.50000000 1.0 
      0.74000000       0.24000000       0.50000000 1.0 
      0.76000000       0.26000000       0.50000000 1.0 
      0.78000000       0.28000000       0.50000000 1.0 
      0.80000000       0.30000000       0.50000000 1.0 
      0.82000000       0.32000000       0.50000000 1.0 
      0.84000000       0.34000000       0.50000000 1.0 
      0.86000000       0.36000000       0.50000000 1.0 
      0.88000000       0.38000000       0.50000000 1.0 
      0.90000000       0.40000000       0.50000000 1.0 
      0.92000000       0.42000000       0.50000000 1.0 
      0.94000000       0.44000000       0.50000000 1.0 
      0.96000000       0.46000000       0.50000000 1.0 
      0.98000000       0.48000000       0.50000000 1.0 
      1.00000000       0.50000000       0.50000000 1.0 
      1.00000000       0.50000000       0.50000000 1.0 
      0.98387097       0.50000000       0.48387097 1.0 
      0.96774194       0.50000000       0.46774194 1.0 
      0.95161290       0.50000000       0.45161290 1.0 
      0.93548387       0.50000000       0.43548387 1.0 
      0.91935484       0.50000000       0.41935484 1.0 
      0.90322581       0.50000000       0.40322581 1.0 
      0.88709677       0.50000000       0.38709677 1.0 
      0.87096774       0.50000000       0.37096774 1.0 
      0.85483871       0.50000000       0.35483871 1.0 
      0.83870968       0.50000000       0.33870968 1.0 
      0.82258065       0.50000000       0.32258065 1.0 
      0.80645161       0.50000000       0.30645161 1.0 
      0.79032258       0.50000000       0.29032258 1.0 
      0.77419355       0.50000000       0.27419355 1.0 
      0.75806452       0.50000000       0.25806452 1.0 
      0.74193548       0.50000000       0.24193548 1.0 
      0.72580645       0.50000000       0.22580645 1.0 
      0.70967742       0.50000000       0.20967742 1.0 
      0.69354839       0.50000000       0.19354839 1.0 
      0.67741935       0.50000000       0.17741935 1.0 
      0.66129032       0.50000000       0.16129032 1.0 
      0.64516129       0.50000000       0.14516129 1.0 
      0.62903226       0.50000000       0.12903226 1.0 
      0.61290323       0.50000000       0.11290323 1.0 
      0.59677419       0.50000000       0.09677419 1.0 
      0.58064516       0.50000000       0.08064516 1.0 
      0.56451613       0.50000000       0.06451613 1.0 
      0.54838710       0.50000000       0.04838710 1.0 
      0.53225806       0.50000000       0.03225806 1.0 
      0.51612903       0.50000000       0.01612903 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.48000000       0.48000000       0.00000000 1.0 
      0.46000000       0.46000000       0.00000000 1.0 
      0.44000000       0.44000000       0.00000000 1.0 
      0.42000000       0.42000000       0.00000000 1.0 
      0.40000000       0.40000000       0.00000000 1.0 
      0.38000000       0.38000000       0.00000000 1.0 
      0.36000000       0.36000000       0.00000000 1.0 
      0.34000000       0.34000000       0.00000000 1.0 
      0.32000000       0.32000000       0.00000000 1.0 
      0.30000000       0.30000000       0.00000000 1.0 
      0.28000000       0.28000000       0.00000000 1.0 
      0.26000000       0.26000000       0.00000000 1.0 
      0.24000000       0.24000000       0.00000000 1.0 
      0.22000000       0.22000000       0.00000000 1.0 
      0.20000000       0.20000000       0.00000000 1.0 
      0.18000000       0.18000000       0.00000000 1.0 
      0.16000000       0.16000000       0.00000000 1.0 
      0.14000000       0.14000000       0.00000000 1.0 
      0.12000000       0.12000000       0.00000000 1.0 
      0.10000000       0.10000000       0.00000000 1.0 
      0.08000000       0.08000000       0.00000000 1.0 
      0.06000000       0.06000000       0.00000000 1.0 
      0.04000000       0.04000000       0.00000000 1.0 
      0.02000000       0.02000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
     -0.00000000       0.00949295       0.00949295 1.0 
     -0.00000000       0.01898591       0.01898591 1.0 
     -0.00000000       0.02847886       0.02847886 1.0 
     -0.00000000       0.03797181       0.03797181 1.0 
     -0.00000000       0.04746477       0.04746477 1.0 
     -0.00000000       0.05695772       0.05695772 1.0 
     -0.00000000       0.06645067       0.06645067 1.0 
     -0.00000000       0.07594363       0.07594363 1.0 
     -0.00000000       0.08543658       0.08543658 1.0 
     -0.00000000       0.09492953       0.09492953 1.0 
     -0.00000000       0.10442249       0.10442249 1.0 
     -0.00000000       0.11391544       0.11391544 1.0 
     -0.00000000       0.12340839       0.12340839 1.0 
     -0.00000000       0.13290135       0.13290135 1.0 
     -0.00000000       0.14239430       0.14239430 1.0 
     -0.00000000       0.15188725       0.15188725 1.0 
     -0.00000000       0.16138021       0.16138021 1.0 
     -0.00000000       0.17087316       0.17087316 1.0 
     -0.00000000       0.18036611       0.18036611 1.0 
     -0.00000000       0.18985907       0.18985907 1.0 
     -0.00000000       0.19935202       0.19935202 1.0 
     -0.00000000       0.20884497       0.20884497 1.0 
     -0.00000000       0.21833793       0.21833793 1.0 
     -0.00000000       0.22783088       0.22783088 1.0 
     -0.00000000       0.23732383       0.23732383 1.0 
     -0.00000000       0.24681679       0.24681679 1.0 
     -0.00000000       0.25630974       0.25630974 1.0 
     -0.00000000       0.26580269       0.26580269 1.0 
     -0.00000000       0.27529565       0.27529565 1.0 
     -0.00000000       0.28478860       0.28478860 1.0 
     -0.00000000       0.29428155       0.29428155 1.0 
     -0.00000000       0.30377451       0.30377451 1.0 
     -0.00000000       0.31326746       0.31326746 1.0 
     -0.00000000       0.32276041       0.32276041 1.0 
     -0.00000000       0.33225337       0.33225337 1.0 
     -0.00000000       0.34174632       0.34174632 1.0 
     -0.00000000       0.35123927       0.35123927 1.0 
     -0.00000000       0.36073223       0.36073223 1.0 
     -0.00000000       0.37022518       0.37022518 1.0 
     -0.00000000       0.37971813       0.37971813 1.0 
     -0.00000000       0.38921109       0.38921109 1.0 
     -0.00000000       0.39870404       0.39870404 1.0 
     -0.00000000       0.39870404       0.39870404 1.0 
      0.01351351       0.39383726       0.40735077 1.0 
      0.02702703       0.38897048       0.41599751 1.0 
      0.04054054       0.38410370       0.42464424 1.0 
      0.05405405       0.37923692       0.43329097 1.0 
      0.06756757       0.37437014       0.44193771 1.0 
      0.08108108       0.36950336       0.45058444 1.0 
      0.09459459       0.36463658       0.45923117 1.0 
      0.10810811       0.35976980       0.46787791 1.0 
      0.12162162       0.35490302       0.47652464 1.0 
      0.13513514       0.35003624       0.48517138 1.0 
      0.14864865       0.34516946       0.49381811 1.0 
      0.16216216       0.34030268       0.50246484 1.0 
      0.17567568       0.33543590       0.51111158 1.0 
      0.18918919       0.33056912       0.51975831 1.0 
      0.20270270       0.32570234       0.52840504 1.0 
      0.21621622       0.32083556       0.53705178 1.0 
      0.22972973       0.31596878       0.54569851 1.0 
      0.24324324       0.31110200       0.55434525 1.0 
      0.25675676       0.30623522       0.56299198 1.0 
      0.27027027       0.30136844       0.57163871 1.0 
      0.28378378       0.29650166       0.58028545 1.0 
      0.29729730       0.29163488       0.58893218 1.0 
      0.31081081       0.28676810       0.59757891 1.0 
      0.32432432       0.28190132       0.60622565 1.0 
      0.33783784       0.27703454       0.61487238 1.0 
      0.35135135       0.27216776       0.62351912 1.0 
      0.36486486       0.26730098       0.63216585 1.0 
      0.37837838       0.26243420       0.64081258 1.0 
      0.39189189       0.25756742       0.64945932 1.0 
      0.40540541       0.25270064       0.65810605 1.0 
      0.41891892       0.24783386       0.66675278 1.0 
      0.43243243       0.24296709       0.67539952 1.0 
      0.44594595       0.23810031       0.68404625 1.0 
      0.45945946       0.23323353       0.69269298 1.0 
      0.47297297       0.22836675       0.70133972 1.0 
      0.48648649       0.22349997       0.70998645 1.0 
      0.50000000       0.21863319       0.71863319 1.0 
      0.50000000       0.21863319       0.71863319 1.0 
      0.50000000       0.20912740       0.70912740 1.0 
      0.50000000       0.19962160       0.69962160 1.0 
      0.50000000       0.19011581       0.69011581 1.0 
      0.50000000       0.18061002       0.68061002 1.0 
      0.50000000       0.17110423       0.67110423 1.0 
      0.50000000       0.16159844       0.66159844 1.0 
      0.50000000       0.15209265       0.65209265 1.0 
      0.50000000       0.14258686       0.64258686 1.0 
      0.50000000       0.13308107       0.63308107 1.0 
      0.50000000       0.12357528       0.62357528 1.0 
      0.50000000       0.11406949       0.61406949 1.0 
      0.50000000       0.10456370       0.60456370 1.0 
      0.50000000       0.09505791       0.59505791 1.0 
      0.50000000       0.08555212       0.58555212 1.0 
      0.50000000       0.07604633       0.57604633 1.0 
      0.50000000       0.06654053       0.56654053 1.0 
      0.50000000       0.05703474       0.55703474 1.0 
      0.50000000       0.04752895       0.54752895 1.0 
      0.50000000       0.03802316       0.53802316 1.0 
      0.50000000       0.02851737       0.52851737 1.0 
      0.50000000       0.01901158       0.51901158 1.0 
      0.50000000       0.00950579       0.50950579 1.0 
      0.50000000       0.00000000       0.50000000 1.0 
      1.00000000       0.50000000       0.50000000 1.0 
      1.00000000       0.50920872       0.50920872 1.0 
      1.00000000       0.51841745       0.51841745 1.0 
      1.00000000       0.52762617       0.52762617 1.0 
      1.00000000       0.53683490       0.53683490 1.0 
      1.00000000       0.54604362       0.54604362 1.0 
      1.00000000       0.55525234       0.55525234 1.0 
      1.00000000       0.56446107       0.56446107 1.0 
      1.00000000       0.57366979       0.57366979 1.0 
      1.00000000       0.58287851       0.58287851 1.0 
      1.00000000       0.59208724       0.59208724 1.0 
      1.00000000       0.60129596       0.60129596 1.0 
     -0.00000000       0.39870404       0.39870404 1.0 
      0.01785714       0.41237057       0.39451342 1.0 
      0.03571429       0.42603709       0.39032281 1.0 
      0.05357143       0.43970362       0.38613219 1.0 
      0.07142857       0.45337015       0.38194158 1.0 
      0.08928571       0.46703668       0.37775096 1.0 
      0.10714286       0.48070320       0.37356035 1.0 
      0.12500000       0.49436973       0.36936973 1.0 
      0.14285714       0.50803626       0.36517912 1.0 
      0.16071429       0.52170279       0.36098850 1.0 
      0.17857143       0.53536932       0.35679789 1.0 
      0.19642857       0.54903584       0.35260727 1.0 
      0.21428571       0.56270237       0.34841666 1.0 
      0.23214286       0.57636890       0.34422604 1.0 
      0.25000000       0.59003543       0.34003543 1.0 
      0.26785714       0.60370195       0.33584481 1.0 
      0.28571429       0.61736848       0.33165420 1.0 
      0.30357143       0.63103501       0.32746358 1.0 
      0.32142857       0.64470154       0.32327297 1.0 
      0.33928571       0.65836806       0.31908235 1.0 
      0.35714286       0.67203459       0.31489174 1.0 
      0.37500000       0.68570112       0.31070112 1.0 
      0.39285714       0.69936765       0.30651050 1.0 
      0.41071429       0.71303418       0.30231989 1.0 
      0.42857143       0.72670070       0.29812927 1.0 
      0.44642857       0.74036723       0.29393866 1.0 
      0.46428571       0.75403376       0.28974804 1.0 
      0.48214286       0.76770029       0.28555743 1.0 
      0.50000000       0.78136681       0.28136681 1.0 
      0.50000000       0.78136681       0.28136681 1.0 
      0.50000000       0.77166451       0.27166451 1.0 
      0.50000000       0.76196221       0.26196221 1.0 
      0.50000000       0.75225990       0.25225990 1.0 
      0.50000000       0.74255760       0.24255760 1.0 
      0.50000000       0.73285529       0.23285529 1.0 
      0.50000000       0.72315299       0.22315299 1.0 
      0.50000000       0.71345069       0.21345069 1.0 
      0.50000000       0.70374838       0.20374838 1.0 
      0.50000000       0.69404608       0.19404608 1.0 
      0.50000000       0.68434377       0.18434377 1.0 
      0.50000000       0.67464147       0.17464147 1.0 
      0.50000000       0.66493917       0.16493917 1.0 
      0.50000000       0.65523686       0.15523686 1.0 
      0.50000000       0.64553456       0.14553456 1.0 
      0.50000000       0.63583225       0.13583225 1.0 
      0.50000000       0.62612995       0.12612995 1.0 
      0.50000000       0.61642765       0.11642765 1.0 
      0.50000000       0.60672534       0.10672534 1.0 
      0.50000000       0.59702304       0.09702304 1.0 
      0.50000000       0.58732074       0.08732074 1.0 
      0.50000000       0.57761843       0.07761843 1.0 
      0.50000000       0.56791613       0.06791613 1.0 
      0.50000000       0.55821382       0.05821382 1.0 
      0.50000000       0.54851152       0.04851152 1.0 
      0.50000000       0.53880922       0.03880922 1.0 
      0.50000000       0.52910691       0.02910691 1.0 
      0.50000000       0.51940461       0.01940461 1.0 
      0.50000000       0.50970230       0.00970230 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.48484848       0.48484848       0.48484848 1.0 
      0.46969697       0.46969697       0.46969697 1.0 
      0.45454545       0.45454545       0.45454545 1.0 
      0.43939394       0.43939394       0.43939394 1.0 
      0.42424242       0.42424242       0.42424242 1.0 
      0.40909091       0.40909091       0.40909091 1.0 
      0.39393939       0.39393939       0.39393939 1.0 
      0.37878788       0.37878788       0.37878788 1.0 
      0.36363636       0.36363636       0.36363636 1.0 
      0.34848485       0.34848485       0.34848485 1.0 
      0.33333333       0.33333333       0.33333333 1.0 
      0.31818182       0.31818182       0.31818182 1.0 
      0.30303030       0.30303030       0.30303030 1.0 
      0.28787879       0.28787879       0.28787879 1.0 
      0.27272727       0.27272727       0.27272727 1.0 
      0.25757576       0.25757576       0.25757576 1.0 
      0.24242424       0.24242424       0.24242424 1.0 
      0.22727273       0.22727273       0.22727273 1.0 
      0.21212121       0.21212121       0.21212121 1.0 
      0.19696970       0.19696970       0.19696970 1.0 
      0.18181818       0.18181818       0.18181818 1.0 
      0.16666667       0.16666667       0.16666667 1.0 
      0.15151515       0.15151515       0.15151515 1.0 
      0.13636364       0.13636364       0.13636364 1.0 
      0.12121212       0.12121212       0.12121212 1.0 
      0.10606061       0.10606061       0.10606061 1.0 
      0.09090909       0.09090909       0.09090909 1.0 
      0.07575758       0.07575758       0.07575758 1.0 
      0.06060606       0.06060606       0.06060606 1.0 
      0.04545455       0.04545455       0.04545455 1.0 
      0.03030303       0.03030303       0.03030303 1.0 
      0.01515152       0.01515152       0.01515152 1.0 
      0.00000000       0.00000000       0.00000000 1.0 

